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1-(1,3-DIOXOLAN-2-YLMETHYL)-2-METHYLBENZENE, with the molecular formula C11H14O2, is a chemical compound derived from benzene. It features a dioxolane ring and a methyl group attached to the benzene ring, which impart unique reactivity and properties to the molecule. This versatile intermediate is widely utilized in organic synthesis for creating complex molecules and materials.

89012-55-5

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89012-55-5 Usage

Uses

Used in Pharmaceutical Industry:
1-(1,3-DIOXOLAN-2-YLMETHYL)-2-METHYLBENZENE is used as a building block for the synthesis of various pharmaceutical compounds. Its unique structure and reactivity allow for the development of new drugs with potential therapeutic applications.
Used in Agrochemical Industry:
In the agrochemical sector, 1-(1,3-DIOXOLAN-2-YLMETHYL)-2-METHYLBENZENE serves as a key intermediate in the production of agrochemicals. Its properties enable the creation of novel compounds with improved efficacy and selectivity in pest control and crop protection.
Used in Material Science:
1-(1,3-DIOXOLAN-2-YLMETHYL)-2-METHYLBENZENE is also utilized in material science as a component in the development of advanced materials. Its incorporation into material formulations can lead to enhanced properties such as improved strength, durability, or chemical resistance.
Overall, 1-(1,3-DIOXOLAN-2-YLMETHYL)-2-METHYLBENZENE is a valuable compound in various industries due to its unique structure and reactivity, making it a promising intermediate for the synthesis of complex molecules and materials with diverse applications.

Check Digit Verification of cas no

The CAS Registry Mumber 89012-55-5 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 8,9,0,1 and 2 respectively; the second part has 2 digits, 5 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 89012-55:
(7*8)+(6*9)+(5*0)+(4*1)+(3*2)+(2*5)+(1*5)=135
135 % 10 = 5
So 89012-55-5 is a valid CAS Registry Number.
InChI:InChI=1/C11H14O2/c1-9-4-2-3-5-10(9)8-11-12-6-7-13-11/h2-5,11H,6-8H2,1H3

89012-55-5SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-[(2-methylphenyl)methyl]-1,3-dioxolane

1.2 Other means of identification

Product number -
Other names 1,3-Dioxolane,2-[(2-methylphenyl)methyl]

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:89012-55-5 SDS

89012-55-5Downstream Products

89012-55-5Relevant academic research and scientific papers

Direct synthesis of protected arylacetaldehydes by tetrakis(phosphane)- palladium-catalyzed arylation of ethyleneglycol vinyl ether

Kondolff, Isabelle,Doucet, Henri,Santelli, Maurice

, p. 765 - 774 (2007/10/03)

A range of aryl bromides undergo Heck reaction with ethylene glycol vinyl ether, in the presence of [PdCl(C3H5)]2/ cis,cis,cis-1,2,3,4-tetrakis[(diphenylphosphanyl)methyl]cyclopentane as catalyst, to give regioselectively protected arylacetaldehydes in good yields. The β-arylation products were obtained in with 93-100 % selectivity with electron-poor aryl bromides or heteroaryl bromides. Furthermore, this catalyst can be used at low loading, even for reactions with sterically hindered aryl bromides. The aryl vinyl ether intermediates undergo subsequent ketalisation to give the corresponding 2-benzyl-1,3-dioxolane derivatives. Wiley-VCH Verlag GmbH & Co. KGaA, 2006.

Direct synthesis of protected arylacetaldehydes by palladium- tetraphosphine-catalyzed arylation of ethyleneglycol vinylether

Kondolff, Isabelle,Doucet, Henri,Santelli, Maurice

, p. 1561 - 1564 (2007/10/03)

Through the use of [PdCl(C3H5)]2/cis,cis, cis-1,2,3,4-tetrakis(diphenylphosphinomethyl) cyclopentane as a catalyst, a range of aryl bromides undergo Heck reaction with ethyleneglycol vinylether to give regioselectively protected arylacetaldehydes in good yields. The β-arylation products were obtained in the range 93-98% selectivity with electron-poor aryl bromides. Furthermore, this catalyst can be used at low loading, even for reactions of sterically hindered aryl bromides. The arylvinyl ethers intermediates undergo subsequent ketalization to give the corresponding 2-benzyl-1,3-dioxolane derivatives.

Palladium(II)-Catalyzed Acetalization of Terminal Olefins Bearing Electron-Withdrawing Substituents with Optically Active Diols

Hosokawa, Takahiro,Ohta, Toshiyuki,Kanayama, Satoshi,Murahashi, Shun-Ichi

, p. 1758 - 1764 (2007/10/02)

Terminal olefins bearing electron-withdrawing substituents such as CH2=CHCOR (R=Ph, Me, t-Bu), CH2=CHCOOMe, and CH2=CHCN are regioselectively acetalized at the terminal carbon (C1) by diols in the presence of PdCl2 (0.1 equiv) and CuCl (1 equiv) in DME at 50 deg C under an atmosphere of O2 (1 atm).The use of optically active (R,R)-2,4-pentanediol (4) gives homochiral cyclic acetals of aldehyde precursors in good yields.The acetalization of CH2=CHCOR is accompanied by the formation of Michael-type adducts such as 3a (R=Ph).However, of importance is that their formation can be prevented by the use of Na2HPO4 as an additive.Although in an early stage of the reaction of CD2=CHPh with 4, a statistical d scrambling of the starting olefin occurs, no such scrambling is observed with CD2=CHCOPh.Additionally, the acetalization of CD2=CHCOPh with 4 results in 1,2 deuterium migration, together with 25percent d loss.These results are accounted for by the reaction pathways involving oxypalladation, Pd-H elimination, and subsequent ring closure giving enol ether.A catalytic cycle involving the oxygenation of Pd-H species with molecular oxygen is proposed.

Palladium(II)-catalysed Acetalization of Terminal Olefins Bearing Electron-withdrawing Substituents with 1,3- and 1,2-Diols

Hosokawa, Takahiro,Ohta, Toshiyuki,Murahashi, Shun-Ichi

, p. 848 - 849 (2007/10/02)

Treatment of terminal olefins bearing electron-withdrawing groups with (R,R)-pentane-2,4-diol (2) in the presence of PdCl2-CuCl-O2 in 1,2-dimethoxyethane gives cyclic acetals such as (3) and (12b) via attack at the terminal carbon atom; the corresponding acetals are similarly formed from propane-1,3-diol (5) and ethylene glycol (8).

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